| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 29th, 2008 | 17 | No |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.10 | -0.01 | -7.41 | 4 | 6 | 0 | 100 | 361.981 | 1 | ↓ |
| Ref Reference (pH 7) | 2.10 | 0.1 | -8.49 | 4 | 6 | 0 | 100 | 361.981 | 1 | ↓ |
| Hi High (pH 8-9.5) | 3.01 | -0.7 | -9.88 | 4 | 6 | 0 | 108 | 361.981 | 1 | ↓ |
| Hi High (pH 8-9.5) | 3.01 | -1.76 | -24.35 | 4 | 6 | 0 | 108 | 361.981 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.56 | -1.66 | -37.99 | 3 | 6 | -1 | 103 | 360.973 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.56 | -1.9 | -36.02 | 3 | 6 | -1 | 103 | 360.973 | 1 | ↓ |
